Glycoside
...
GD147781

Name:
2-[4-(5-{2-[3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydro-1-benzofuran-4-yl]ethenyl}-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl)-2,6-dihydroxyphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:
C54H52O19

Smiles:
OCC1OC(c2c(O)cc(C3c4cc(C=Cc5cc(O)c(C6OC(CO)C(O)C(O)C6O)c6c5C(c5cc(O)cc(O)c5)C(c5ccc(O)cc5)O6)ccc4OC3c3ccc(O)cc3)cc2O)C(O)C(O)C1O

Aglycone:
Oc1ccc(C2Oc3ccc(C=Cc4cc(O)cc5c4C(c4cc(O)cc(O)c4)C(c4ccc(O)cc4)O5)cc3C2c2cc(O)cc(O)c2)cc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 10
HBD: 15 FractionCSP3: 0.3
AlogP: 3.36 Num_rotatable_bonds: 10
MolWt: 1004.99 Num_heavy_atoms: 73
TPSA: 340.37 NumAromaticRings: 6

Unique Aglycone
AD59168
Formula: C42H32O9

Smiles:
Oc1ccc(C2Oc3ccc(C=Cc4cc(O)cc5c4C(c4cc(O)cc(O)c4)C(c4ccc(O)cc4)O5)cc3C2c2cc(O)cc(O)c2)cc1
HBA: 9 RingCount: 8
HBD: 7 FractionCSP3: 0.1
AlogP: 8.33 Num_rotatable_bonds: 6
MolWt: 680.71 Num_heavy_atoms: 51
TPSA: 160.07 NumAromaticRings: 6

Sugarmoiety
SD00019

OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O